1MUO

CRYSTAL STRUCTURE OF AURORA-2, AN ONCOGENIC SERINE-THREONINE KINASE

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	EMBL/DESY, HAMBURG BEAMLINE X31
Synchrotron site	EMBL/DESY, HAMBURG
Beamline	X31
Temperature [K]	100
Detector technology	CCD
Collection date	2001-09-05
Detector	MARRESEARCH
Wavelength(s)	0.802
Spacegroup name	P 32 2 1
Unit cell lengths	86.200, 86.200, 75.400
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	18.000 - 2.900
R-factor	0.26
Rwork	0.240
R-free	0.29000
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.015
RMSD bond angle	1.970
Data reduction software	MOSFLM
Data scaling software	SCALA
Phasing software	CNS
Refinement software	CNS

Data quality characteristics

	Overall
Low resolution limit [Å]	18.000 *
High resolution limit [Å]	2.900
Rmerge	0.063 *
Total number of observations	17936 *
Number of reflections	7275
<I/σ(I)>	18.6
Completeness [%]	97.3
Redundancy	2.5

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	6	293	PEG 3350, ammonium sulphate, MES, pH 6.0, VAPOR DIFFUSION, HANGING DROP, temperature 293K

Crystallization Reagents in Literatures

ID	crystal ID	solution	reagent name	concentration (unit)	details
1	1	reservoir	PEG3350	21 (%)
2	1	reservoir	ammonium sulfate	0.2 (M)
3	1	reservoir	MES	0.1 (M)	pH6.0